[3-fluoro-1-(oxolan-3-yl)pyrrolidin-3-yl]methanol

C9H16FNO2 — CID 126991303

IUPAC[3-fluoro-1-(oxolan-3-yl)pyrrolidin-3-yl]methanol
SMILESOCC1(F)CCN(C2CCOC2)C1
InChIInChI=1S/C9H16FNO2/c10-9(7-12)2-3-11(6-9)8-1-4-13-5-8/h8,12H,1-7H2
InChIKeyXHFJGFFEEVZDAE-UHFFFAOYSA-N
MW189.23 g/mol
LogP0.18
Rot. Bonds2

About [3-fluoro-1-(oxolan-3-yl)pyrrolidin-3-yl]methanol

[3-fluoro-1-(oxolan-3-yl)pyrrolidin-3-yl]methanol (PubChem CID 126991303) has the molecular formula C9H16FNO2 and a molecular weight of 189.23 g/mol. Its IUPAC name is [3-fluoro-1-(oxolan-3-yl)pyrrolidin-3-yl]methanol.

Molecular Properties

Compound Name[3-fluoro-1-(oxolan-3-yl)pyrrolidin-3-yl]methanol
PubChem CID126991303
Molecular FormulaC9H16FNO2
Molecular Weight189.23 g/mol
Exact Mass189.12
IUPAC Name[3-fluoro-1-(oxolan-3-yl)pyrrolidin-3-yl]methanol
SMILESOCC1(F)CCN(C2CCOC2)C1
InChIInChI=1S/C9H16FNO2/c10-9(7-12)2-3-11(6-9)8-1-4-13-5-8/h8,12H,1-7H2
InChIKeyXHFJGFFEEVZDAE-UHFFFAOYSA-N
XLogP0.18
TPSA32.70 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500189.23
LogP ≤ 50.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

[1-[2-(2,2,2-Trifluoroethoxy)ethyl]pyrrolidin-3-yl]methanol
CID 62373131
[1-[2-(2,2-Difluoroethoxy)ethyl]pyrrolidin-3-yl]methanol
CID 102977716
3-Fluoro-3-methyl-1-(oxolan-3-yl)pyrrolidine
CID 131176316
1-(Oxolan-3-yl)-3-(trifluoromethyl)pyrrolidin-3-ol
CID 132286802
ethane;fluoromethane;[(3R)-1-(oxetan-3-yl)pyrrolidin-3-yl]methanol
CID 166157690
[1-(Oxolan-3-yl)pyrrolidin-3-yl]methanol
CID 63563071
[1-(1-Methoxypropan-2-yl)pyrrolidin-3-yl]methanol
CID 64121238
[1-(1-Methoxybutan-2-yl)pyrrolidin-3-yl]methanol
CID 64866267
[1-(1-Ethoxypropan-2-yl)pyrrolidin-3-yl]methanol
CID 64867339
[1-(1-Methoxy-3-methylbutan-2-yl)pyrrolidin-3-yl]methanol
CID 65053095
[1-(2-Methyloxolan-3-yl)pyrrolidin-3-yl]methanol
CID 82736434
[3-[[Methyl(oxolan-3-yl)amino]methyl]oxolan-3-yl]methanol
CID 82754504

Frequently Asked Questions

What is the IUPAC name of [3-fluoro-1-(oxolan-3-yl)pyrrolidin-3-yl]methanol?
The IUPAC name of [3-fluoro-1-(oxolan-3-yl)pyrrolidin-3-yl]methanol (CID 126991303) is [3-fluoro-1-(oxolan-3-yl)pyrrolidin-3-yl]methanol.
What is the SMILES notation for [3-fluoro-1-(oxolan-3-yl)pyrrolidin-3-yl]methanol?
The canonical SMILES for [3-fluoro-1-(oxolan-3-yl)pyrrolidin-3-yl]methanol is OCC1(F)CCN(C2CCOC2)C1.
What is the InChIKey of [3-fluoro-1-(oxolan-3-yl)pyrrolidin-3-yl]methanol?
The InChIKey is XHFJGFFEEVZDAE-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H16FNO2/c10-9(7-12)2-3-11(6-9)8-1-4-13-5-8/h8,12H,1-7H2.
What are the key properties of [3-fluoro-1-(oxolan-3-yl)pyrrolidin-3-yl]methanol?
[3-fluoro-1-(oxolan-3-yl)pyrrolidin-3-yl]methanol has a molecular weight of 189.23 g/mol, XLogP of 0.18, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [3-fluoro-1-(oxolan-3-yl)pyrrolidin-3-yl]methanol is sourced from PubChem (CID 126991303), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).